SCHEMBL13434840

SCHEMBL13434840

NC(=O)c1ccc(Nc2ncnc3ccsc23)c(OCCC(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 7/20 0.45
MKNK1 Q9BUB5 2/20 0.44
NTRK1 P04629 3/20 0.41
BRAF P15056 1/20 0.39
TNNI3K Q59H18 1/20 0.39
AURKA O14965 4/20 0.38
TEK Q02763 1/20 0.38
AURKB Q96GD4 1/20 0.38
FADS1 O60427 1/20 0.37
EGFR P00533 1/20 0.37
FLT1 P17948 1/20 0.37
PIP4K2C Q8TBX8 1/20 0.36
SYK P43405 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15428425 0.93 MKNK2 (0.45) MKNK2MKNK1NTRK1BRAFTNNI3K
SCHEMBL13434873 0.85 MKNK2 (0.50) MKNK2MKNK1FLT1
SCHEMBL3805698 0.85 MKNK2 (0.49) MKNK2MKNK1EGFR
SCHEMBL13434847 0.84 MKNK2 (0.54) MKNK2MKNK1NTRK1BRAFTNNI3K
SCHEMBL13434846 0.83 MKNK2 (0.48) MKNK2MKNK1
SCHEMBL13434841 0.81 MKNK2 (0.57) MKNK2MKNK1BRAFTNNI3KFADS1
SCHEMBL13434852 0.79 MKNK2 (0.48) MKNK2MKNK1BRAFTNNI3KPIP4K2C
SCHEMBL3794267 0.79 MKNK2 (0.56) MKNK2MKNK1
SCHEMBL13434842 0.78 MKNK2 (0.44) MKNK2MKNK1NTRK1BRAFTNNI3K
SCHEMBL3804107 0.77 MKNK2 (0.65) MKNK2MKNK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633201-B2 Thienopyrimidines having Mnk1/Mnk2 inhibiting activity for pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-21 US disclosed
US-8633201-B2 Thienopyrimidines having Mnk1/Mnk2 inhibiting activity for pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-21 US disclosed
EP-2004656-B1 THIENOPYRIMIDINES HAVING MNK1 /MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2013-07-10 EP disclosed
US-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-03-04 US disclosed
US-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-03-04 US disclosed
WO-2007115822-A1 THIENOPYRIMIDINES HAVING MNKL /MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2007-10-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS CMPK1, DTYMK, NEK9 MKNK2 8/4885MKNK1 29/4885NTRK1 1848/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.